4-Bromopyridine

C₅H₄BrNCAS 1120-87-2158.00 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₄BrN
Molar mass: 158.00 g/mol
Exact mass: 156.9527 Da
Melting point: 0.5 °C
Boiling point: 28–30 °C
logP: 1.84Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 0

Identifiers

CAS number

1120-87-2

SMILES

Brc1ccncc1

InChIKey

BSDGZUDFPKIYQG-UHFFFAOYSA-N

InChI

InChI=1S/C5H4BrN/c6-5-1-3-7-4-2-5/h1-4H

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Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names

Pyridine, 4-bromo-
Pyridin-4-yl bromide

Work with 4-Bromopyridine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Bromopyridine hydrochloride19524-06-282 % similar 4-(4-Bromophenyl)pyridine39795-60-368 % similar 1,4-Dibromobenzene106-37-653 % similar 4,4'-Bipyridine553-26-447 % similar 4,4′-Dibromo-2,2′-bipyridine18511-71-245 % similar 4-Bromothiophenol106-53-645 % similar Bromobenzene108-86-144 % similar 1,4-Bis(pyrid-4-yl)benzene113682-56-744 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Bromopyridine109-04-6 3-Bromopyridine626-55-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook